cyclohexyl-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone

Systemtic Name: cyclohexyl-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone Openeye Name: cyclohexyl-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone CAS Name: cyclohexyl-[4-(6,7-dimethyl-3-phenyl-2-quinoxalinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: cyclohexyl-[4-(6,7-dimethyl-3-phenylquinoxalin-2-yl)-1,4-diazepan-1-yl]methanone Traditional Name: cyclohexyl-[4-(6,7-dimethyl-3-phenyl-quinoxalin-2-yl)-1,4-diazepan-1-yl]methanone Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(C(=N2)C3=CC=CC=C3)N4CCCN(CC4)C(=O)C5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(C(=N2)C3=CC=CC=C3)N4CCCN(CC4)C(=O)C5CCCCC5

InChI

InChI=1S/C28H34N4O/c1-20-18-24-25(19-21(20)2)30-27(26(29-24)22-10-5-3-6-11-22)31-14-9-15-32(17-16-31)28(33)23-12-7-4-8-13-23/h3,5-6,10-11,18-19,23H,4,7-9,12-17H2,1-2H3